Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTNNB1 | P35222 | 1/20 | 0.68 |
| ▸ | SOS1 | Q07889 | 2/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.55 |
| ▸ | HTT | P42858 | 1/20 | 0.55 |
| ▸ | CA2 | P00918 | 7/20 | 0.51 |
| ▸ | CA1 | P00915 | 5/20 | 0.51 |
| ▸ | CA9 | Q16790 | 5/20 | 0.51 |
| ▸ | CA12 | O43570 | 4/20 | 0.51 |
| ▸ | CA4 | P22748 | 2/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.45 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.45 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.44 |
| ▸ | CA7 | P43166 | 2/20 | 0.44 |
| ▸ | IKBKB | O14920 | 1/20 | 0.44 |
| ▸ | CHUK | O15111 | 1/20 | 0.44 |
| ▸ | CA5A | P35218 | 1/20 | 0.43 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.43 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL2662702 | 0.86 | CTNNB1 (0.66) | CTNNB1HTTSMN1; SMN2PARP10IRAK4 | |
| SCHEMBL7688158 | 0.84 | CTNNB1 (0.62) | CTNNB1ALDH1A1CA2CA1CA9 | |
| SCHEMBL27680126 | 0.81 | CTNNB1 (1.00) | CTNNB1ALDH1A1HTTSMN1; SMN2PARP10 | |
| SCHEMBL5724 | 0.81 | CTNNB1 (1.00) | CTNNB1ALDH1A1HTTSMN1; SMN2PARP10 | |
| SCHEMBL28876495 | 0.81 | CTNNB1 (1.00) | CTNNB1ALDH1A1HTTSMN1; SMN2PARP10 | |
| SCHEMBL1892492 | 0.80 | CTNNB1 (0.77) | CTNNB1ALDH1A1SMN1; SMN2PARP10IRAK4 | |
| SCHEMBL27800575 | 0.80 | CTNNB1 (0.77) | CTNNB1ALDH1A1SMN1; SMN2PARP10IRAK4 | |
| Hydrochloric Acid SCHEMBL50731 | 0.80 | CTNNB1 (0.96) | CTNNB1ALDH1A1HTTSMN1; SMN2PARP10 | |
| SCHEMBL28081666 | 0.80 | CTNNB1 (0.96) | CTNNB1ALDH1A1HTTSMN1; SMN2PARP10 | |
| SCHEMBL6368241 | 0.79 | CTNNB1 (0.74) | CTNNB1ALDH1A1HTTSMN1; SMN2PARP10 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2002016356-A2 | QUINUCLIDINE-SUBSTITUTED ARYL MOIETIES FOR TREATMENT OF DISEASE (NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS) | PHARMACIA & UPJOHN COMPANY (US) | 2002-02-28 | — | — | WO | claimed |